N-[(1R,9S)-11-(1-Acetyl-4-piperidinyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenesulfonamide
11972
Reference
N-[(1R,9S)-11-(1-Acetyl-4-piperidinyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenesulfonamide Structure
Systematic / IUPAC Name: N-[(1R,9S)-11-(1-Acetylpiperidin-4-yl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]thiophene-2-sulfonamide
ID: Reference11972
Other Names: NAT11-303799
Formula: C22H28N4O4S2
Spectral Data
N-[(1R,9S)-11-(1-Acetyl-4-piperidinyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenesulfonamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 1428 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/21/2022 2:46:53 PM |
Identificators
| InChI | InChI=1S/C22H28N4O4S2/c1-15(27)24-8-6-18(7-9-24)25-12-16-11-17(14-25)20-5-4-19(22(28)26(20)13-16)23-32(29,30)21-3-2-10-31-21/h2-5,10,16-18,23H,6-9,11-14H2,1H3/t16-,17+/m0/s1 |
| InChI Key | BZHXWLXDPNUZFR-DLBZAZTESA-N |
| Canonical SMILES | CC(=O)N1CCC(CC1)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)NS(=O)(=O)C5=CC=CS5 |
| CAS | |
| Splash | |
| Other Names | NAT11-303799 |